UNRES force field

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UNRES is a united-residue force field for energy-based prediction of protein structure.

Functional form[edit]

Parameters[edit]

References[edit]

  1. A. LIWO, M. R. PINCUS, R. J. WAWAK, S. RACKOVSKY and H. A. SCHERAGA "Calculation of protein backbone geometry from {alpha}-carbon coordinates based on peptide-group dipole alignment", Protein Science 2 pp. 1697-1714 (1993)
  2. Adam Liwo, Jooyoung Lee, Daniel R. Ripoll, Jaroslaw Pillardy, and Harold A. Scheraga "Protein structure prediction by global optimization of a potential energy function", PNAS 96 pp.5482-5485 (1999)

External links[edit]